CHEMBL3665672
| SMILES | Cn1nc(-c2ccccc2)c2c(C(F)(F)F)cc(OCC(=O)N[C@H]3CCc4ccccc43)nc21 |
| InChIKey | NXYUYYGDODQELZ-IBGZPJMESA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 466.2 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| OX1 | OX1R | Human | Orexin | A | pKd | 6.46 | 6.46 | 6.46 | ChEMBL |
| OX2 | OX2R | Human | Orexin | A | pKd | 6.89 | 6.89 | 6.89 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |